| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:56:44 UTC |
|---|
| Update Date | 2025-03-25 00:52:26 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02193771 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C19H22ClNO |
|---|
| Molecular Mass | 315.139 |
|---|
| SMILES | CN(C)CCC1(O)c2ccccc2CCc2cc(Cl)ccc21 |
|---|
| InChI Key | AUDVPUCDSJZZNE-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | dibenzocycloheptenes |
|---|
| Subclass | dibenzocycloheptenes |
|---|
| Direct Parent | dibenzocycloheptenes |
|---|
| Geometric Descriptor | aromatic homopolycyclic compounds |
|---|
| Alternative Parents | 1,3-aminoalcoholsaryl chlorideshydrocarbon derivativesorganochloridesorganopnictogen compoundstertiary alcoholstrialkylamines |
|---|
| Substituents | aryl chloridealcohol1,3-aminoalcoholorganochloridetertiary aliphatic aminearomatic homopolycyclic compoundorganohalogen compounddibenzocycloheptenearyl halidetertiary alcoholorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundaminetertiary amineorganooxygen compound |
|---|
